Name: (6-bromopyrazolo[1,5-a]pyrimidin-2-yl)-(7-methyl-1,4,5,7-tetrahydropyrrolo[2,3-c]pyridin-6-yl)methanone

SMILES: CC1C2=C(CCN1C(=O)C3=NN4C=C(C=NC4=C3)Br)C=CN2

Molecular Processing

Molecular formula

C15H14BrN5O

Molecular weight

360.22

Exact mass

359.0382

XLogP

2.58

TPSA

66.29

H-bond donors

H-bond acceptors

Rotatable bonds

Heavy atoms

Rings

Aromatic rings

Saturated rings

Aliphatic rings

Stereo centers

Undefined stereo

Formal charge

Heteroatoms

Covalent units

Fraction Csp3

0.267

Molar refractivity

84.64

Supplementary Information

InChIKey: HXJWQZLYDJILOA-UHFFFAOYSA-N

Synonyme

SCHEMBL1866068HXJWQZLYDJILOA-UHFFFAOYSA-N(6-bromo-pyrazolo[1,5-a]pyrimidin-2-yl)-(7-methyl-1,4,5,7-tetrahydro-pyrrolo[2,3-c]pyridin-6-yl)-methanone